MMs01270213 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7477 -1.3003 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4523 -1.3003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2477 -1.3029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9955 -2.6033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2432 -3.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7432 -3.8984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2772 -5.3242 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4892 -6.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7043 -5.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0735 -5.9409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2277 -7.4329 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0127 -8.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6434 -7.7000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2886 -5.0613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6578 -5.6738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8729 -4.7942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7187 -3.3022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2421 -5.4067 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4572 -4.5272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3030 -3.0351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5181 -2.1555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8873 -2.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0415 -4.2601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8265 -5.1396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1024 -1.8885 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.9819 -3.1035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2228 -0.6734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3174 -1.0089 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.6867 -1.6214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1632 0.4832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0045 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0403 0.5982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5982 1.0403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0403 -0.5982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0414 -0.1208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3761 -0.8945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9161 -1.8335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9134 -3.3762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 -9.5062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9851 -6.6675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5196 -6.5089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3655 -6.6004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2076 -2.5451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3947 -0.9619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1369 -4.7501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9498 -6.3333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1967 -2.7168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7821 -2.1114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1767 -0.5260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3569 0.6065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0399 1.6768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9696 0.3598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9224 -1.8251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9251 -3.3678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 M END